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4-[2-(4-Butylcyclohexyl)ethyl]-4'-(4-pentylcyclohexyl)-1,1'-biphenyl
SpectraBase Compound ID 2KTvu2REoTT
InChI InChI=1S/C35H52/c1-3-5-7-9-29-16-20-32(21-17-29)34-24-26-35(27-25-34)33-22-18-31(19-23-33)15-14-30-12-10-28(11-13-30)8-6-4-2/h18-19,22-30,32H,3-17,20-21H2,1-2H3
InChIKey OMXWVWDCNNMTTN-UHFFFAOYSA-N
Mol Weight 472.8 g/mol
Molecular Formula C35H52
Exact Mass 472.406902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6uAwJKLg876
Name 4-[2-(4-Butylcyclohexyl)ethyl]-4'-(4-pentylcyclohexyl)-1,1'-biphenyl
CAS Registry Number 86313-18-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H52
InChI InChI=1S/C35H52/c1-3-5-7-9-29-16-20-32(21-17-29)34-24-26-35(27-25-34)33-22-18-31(19-23-33)15-14-30-12-10-28(11-13-30)8-6-4-2/h18-19,22-30,32H,3-17,20-21H2,1-2H3
InChIKey OMXWVWDCNNMTTN-UHFFFAOYSA-N
Molecular Weight 472.801 g/mol
SMILES C(CCC)C1CCC(CC1)CCc1ccc(cc1)-c1ccc(cc1)C1CCC(CC1)CCCCC
SPLASH splash10-00xu-9602400000-9747488b0ac38a3ea643
Synonyms 1,1'-Biphenyl, 4-[2-(4-butylcyclohexyl)ethyl]-4'-(4-pentylcyclohexyl)- 1-(4-amylcyclohexyl)-4-[4-[2-(4-butylcyclohexyl)ethyl]phenyl]benzene 1-[2-(4-butylcyclohexyl)ethyl]-4-[4-(4-pentylcyclohexyl)phenyl]benzene
Wiley ID 1476127